torchani 0.1

torchani/resources/ani-1x_dft_x8ens/train0/networks/ANN-N.nnf-l4.bparam

+!Q$
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torchani/resources/ani-1x_dft_x8ens/train0/networks/ANN-O.nnf-l4.bparam

+--broken encoding: IBM420_ltr
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torchani/resources/ani-1x_dft_x8ens/train0/rHCNO-5.2R_16-3.5A_a4-8.params

+TM = 1
+Rcr = 5.2000e+00
+Rca = 3.5000e+00
+EtaR = [1.6000000e+01]
+ShfR = [9.0000000e-01,1.1687500e+00,1.4375000e+00,1.7062500e+00,1.9750000e+00,2.2437500e+00,2.5125000e+00,2.7812500e+00,3.0500000e+00,3.3187500e+00,3.5875000e+00,3.8562500e+00,4.1250000e+00,4.3937500e+00,4.6625000e+00,4.9312500e+00]
+Zeta = [3.2000000e+01]
+ShfZ = [1.9634954e-01,5.8904862e-01,9.8174770e-01,1.3744468e+00,1.7671459e+00,2.1598449e+00,2.5525440e+00,2.9452431e+00]
+EtaA = [8.0000000e+00]
+ShfA = [9.0000000e-01,1.5500000e+00,2.2000000e+00,2.8500000e+00]
+Atyp = [H,C,N,O]

torchani/resources/ani-1x_dft_x8ens/train0/sae_linfit.dat

+H,0=-0.600952980000
+C,1=-38.08316124000
+N,2=-54.70775770000
+O,3=-75.19446356000